Potassium 4-dibenzothiophenetrifluoroborate
Product Information
Molecular Formula
C12H7BF3KS
Molecular Weight
290.15
Description
Potassium 4-dibenzothiophenetrifluoroborate is a renowned chemical compound extensively employed in the biomedical industry. Its profound efficacy in combating a myriad of ailments such as cancer and infectious diseases renders it an indispensable agent. Functioning as a robust suppressor, it selectively homes in on distinctive enzymes or molecular pathways intricately linked with these afflictions.
Synonyms
Potassium 4-dibenzothienyltrifluoroborate
IUPAC Name
potassiumdibenzothiophen-4-yl(trifluoro)boranuide
SMILES
[B-](C1=C2C(=CC=C1)C3=CC=CC=C3S2)(F)(F)F.[K+]
InChI
InChI=1S/C12H7BF3S.K/c14-13(15,16)10-6-3-5-9-8-4-1-2-7-11(8)17-12(9)10/h1-7H/q-1+1
InChI Key
XYTNZQSGZIYGCR-UHFFFAOYSA-N
Melting Point
289-294 °C
Purity
97%
Safety Information
Hazards
H315-H319-H335
Precautionary Statement
P261-P305 + P351 + P338
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
0
Exact Mass
289.9950675 g/mol
Monoisotopic Mass
289.9950675 g/mol
Topological Polar Surface Area
28.2Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
300
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
2
Compound Is Canonicalized
Yes
